SCHEMBL9844385

SCHEMBL9844385

O=C1OC(CCN2CCC(Cc3ccccc3)CC2)CN1c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.58
SLC6A4 P31645 7/20 0.58
GRM2 Q14416 6/20 0.55
ALDH1A1 P00352 1/20 0.52
SLC6A3 Q01959 2/20 0.48
CCR3 P51677 1/20 0.46
PRMT3 O60678 1/20 0.45
CARM1 Q86X55 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
PRMT1 Q99873 1/20 0.45
PRMT8 Q9NR22 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9844101 0.92 GRM2 (0.64) SLC6A2SLC6A4GRM2CCR3PRMT3
SCHEMBL9844211 0.90 GRM2 (0.55) SLC6A2SLC6A4GRM2ALDH1A1SLC6A3
SCHEMBL9844131 0.90 GRM2 (0.55) SLC6A2SLC6A4GRM2CCR3
SCHEMBL9677253 0.89 GRM2 (0.57) SLC6A2SLC6A4GRM2ALDH1A1CCR3
SCHEMBL7529065 0.89 GRM2 (0.57) SLC6A2SLC6A4GRM2ALDH1A1CCR3
SCHEMBL9844088 0.89 GRM2 (0.52) SLC6A2SLC6A4GRM2ALDH1A1CARM1
SCHEMBL9844291 0.87 GRM2 (0.55) GRM2
Hydrochloric Acid SCHEMBL9844260 0.86 GRM2 (0.54) GRM2
SCHEMBL9844119 0.83 GRM2 (0.56) SLC6A2SLC6A4GRM2
SCHEMBL9844448 0.82 ABCB1 (0.55) SLC6A2SLC6A4GRM2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0443197-A2 Oxazolidinones MERCK PATENT GmbH (DE) 1991-08-28 EP disclosed